| Properties | Image |
| MNX_ID | MNXM1123153 |
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| reference | chebi:160553 |
| formula | C9H15N3O6 |
| global charge | 0 |
| mol weight | 261.234 |
| InChIKey | DTNUIAJCPRMNBT-WHFBIAKZSA-N |
| InChI | InChI=1S/C9H15N3O6/c1-4(9(17)18)12-6(13)3-11-8(16)5(10)2-7(14)15/h4-5H,2-3,10H2,1H3,(H,11,16)(H,12,13)(H,14,15)(H,17,18)/t4-,5-/m0/s1 |
| SMILES | C[C@H](NC(=O)CNC(=O)[C@@H](N)CC(=O)O)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C9H15N3O6/c1-4(9(17)18)12-6(13)3-11-8(16)5(10)2-7(14)15/h4-5H,2-3,10H2,1H3,(H,11,16)(H,12,13)(H,14,15)(H,17,18)/t4-,5-/m0/s1 |
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| SMILES (mnx) | [CH3:1][C@@H:4]([C:9](=[O:17])[OH:18])[N:12]=[C:6]([CH2:3][N:11]=[C:8]([C@H:5]([CH2:2][C:7](=[O:14])[OH:15])[NH2:10])[OH:16])[OH:13] |
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